3-(alpha,gamma-Dicarboxypropyl)(5-(p-di(2-chloroethyl)amino)benzylidene)rhodanine disodium
TL;DR: 3-(alpha,gamma-Dicarboxypropyl)(5-(p-di(2-chloroethyl)amino)benzylidene)rhodanine disodium (CAS 101018-67-1) is a chemical compound with molecular formula C19H18Cl2N2Na2O5S2 and molecular weight 533.983 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
disodium;2-[(5E)-5-[[4-[bis(2-chloroethyl)amino]phenyl]methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]pentanedioate
Also Known As: 3-(alpha,gamma-Dicarboxypropyl)(5-(p-di(2-chloroethyl)amino)benzylidene)rhodanine disodium, Pentanedioic acid, 2-(5-((4-(bis(2-chloroethyl)amino)phenyl)methylene)-4-oxo-2-thioxo-3-thiazolidinyl)-, disodium salt, (+-)-, disodium 2-[(5E)-5-[[4-[bis(2-chloroethyl)amino]phenyl]methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]pentanedioate
Technical Specifications
| Molecular Formula | C19H18Cl2N2Na2O5S2 |
| Molecular Weight | 533.983 g/mol |
| XLogP | -5.1716 |
| Topological Polar Surface Area (TPSA) | 161.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 9 |
| Exact Mass | 533.983 Da |
| Heavy Atoms | 32 |
| Complexity | 681.0 |
| SMILES | C1=CC(=CC=C1/C=C/2\C(=O)N(C(=S)S2)C(CCC(=O)[O-])C(=O)[O-])N(CCCl)CCCl.[Na+].[Na+] |
| InChIKey | KTQMUNYAAZJKGM-BXGYHSFXSA-L |
Chemical Property Profile of 3-(alpha,gamma-Dicarboxypropyl)(5-(p-di(2-chloroethyl)amino)benzylidene)rhodanine disodium
Property Insights of 3-(alpha,gamma-Dicarboxypropyl)(5-(p-di(2-chloroethyl)amino)benzylidene)rhodanine disodium
The XLogP value of -5.1716 indicates that 3-(alpha,gamma-Dicarboxypropyl)(5-(p-di(2-chloroethyl)amino)benzylidene)rhodanine disodium is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 161.0 Ų indicates high polarity, suggesting 3-(alpha,gamma-Dicarboxypropyl)(5-(p-di(2-chloroethyl)amino)benzylidene)rhodanine disodium may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 3-(alpha,gamma-Dicarboxypropyl)(5-(p-di(2-chloroethyl)amino)benzylidene)rhodanine disodium has 0 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 3-(alpha,gamma-Dicarboxypropyl)(5-(p-di(2-chloroethyl)amino)benzylidene)rhodanine disodium?
The CAS number of 3-(alpha,gamma-Dicarboxypropyl)(5-(p-di(2-chloroethyl)amino)benzylidene)rhodanine disodium is 101018-67-1.
What is the molecular formula of 3-(alpha,gamma-Dicarboxypropyl)(5-(p-di(2-chloroethyl)amino)benzylidene)rhodanine disodium?
The molecular formula of 3-(alpha,gamma-Dicarboxypropyl)(5-(p-di(2-chloroethyl)amino)benzylidene)rhodanine disodium is C19H18Cl2N2Na2O5S2.
What is the molecular weight of 3-(alpha,gamma-Dicarboxypropyl)(5-(p-di(2-chloroethyl)amino)benzylidene)rhodanine disodium?
The molecular weight of 3-(alpha,gamma-Dicarboxypropyl)(5-(p-di(2-chloroethyl)amino)benzylidene)rhodanine disodium is 533.983 g/mol.
Where can I buy 3-(alpha,gamma-Dicarboxypropyl)(5-(p-di(2-chloroethyl)amino)benzylidene)rhodanine disodium?
You can request a quote for 3-(alpha,gamma-Dicarboxypropyl)(5-(p-di(2-chloroethyl)amino)benzylidene)rhodanine disodium directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-(alpha,gamma-Dicarboxypropyl)(5-(p-di(2-chloroethyl)amino)benzylidene)rhodanine disodium?
Yes, CoreyChem provides custom synthesis services for 3-(alpha,gamma-Dicarboxypropyl)(5-(p-di(2-chloroethyl)amino)benzylidene)rhodanine disodium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.